1-(azepan-1-yl)-2-[2-[(4-tert-butylphenoxy)methyl]benzimidazol-1-yl]ethanone

Systemtic Name: 1-(azepan-1-yl)-2-[2-[(4-tert-butylphenoxy)methyl]benzimidazol-1-yl]ethanone Openeye Name: 1-(azepan-1-yl)-2-[2-[(4-tert-butylphenoxy)methyl]benzimidazol-1-yl]ethanone CAS Name: 1-(1-azepanyl)-2-[2-[(4-tert-butylphenoxy)methyl]-1-benzimidazolyl]ethanone IUPAC Name: 1-(azepan-1-yl)-2-[2-[(4-tert-butylphenoxy)methyl]benzimidazol-1-yl]ethanone Traditional Name: 1-(azepan-1-yl)-2-[2-[(4-tert-butylphenoxy)methyl]benzimidazol-1-yl]ethanone Formula: C26H33N3O2 MolecularWeight: 419.55912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC2=NC3=CC=CC=C3N2CC(=O)N4CCCCCC4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCC2=NC3=CC=CC=C3N2CC(=O)N4CCCCCC4

InChI

InChI=1S/C26H33N3O2/c1-26(2,3)20-12-14-21(15-13-20)31-19-24-27-22-10-6-7-11-23(22)29(24)18-25(30)28-16-8-4-5-9-17-28/h6-7,10-15H,4-5,8-9,16-19H2,1-3H3